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CAS: 100-21-0
分子式: C8H6O4
分子量: 166.13
熔点: >300 °C
中文名称: 
苯二甲酸
1,4-苯二甲酸
对苯二甲酸
松油苯二甲酸
对酞酸
对苯二(甲)酸
英文名称: 
Terephthalic aicd
PTA
p-Phthalic acid
Terephthalic acid
1,4-Benzenedicarboxylic acid
1,4-dicarboxybenzene
1,4-phthalic acid
acide terephtalique
acide terephtalique (french)
benzene-1,4-dicarboxylic acid
kyselina tereftalova
kyselina tereftalova (czech)
nsc 36973
p-benzenedicarboxylic acid
p-carboxybenzoic acid
p-dicarboxybenzene
p-dicarboxybenzoic acid
para-phthalic acid
phthalic acid (non-specific name)
purified terephthalic acid
ta 12
ta-33mp
tephthol
tpa
wr 16262
Phthalic acid
terephthalicacid
展开更多英文名
性质描述: 白色针状结晶或粉末。可燃。低毒。密度1.510,常压下约在402℃升华,若在密闭容器中加热,可于425℃熔化。溶于碱溶液,微溶于热乙醇,不溶于水、乙醚、冰醋酸和氯仿。
生产方法: 工业上采用最广、最经济的生产方法,是以对二甲苯为原料的高温液相氧化法。对苯二甲酸的其他生产方法还有对二甲苯低温氧化法、苯酐转位法、甲苯氧化歧化法等。1.对二甲苯高温氧化法对二甲苯以乙酸为溶剂,以乙酸钴-乙酸锰为催化剂,以四溴乙烷为助催化剂,于221-225℃,2.5-3.0MPa下氧化生成对苯二甲酸。对苯二甲酸在乙酸中溶解度不大,氧化产物呈泥浆状,经离心分离、干燥后即得粗对苯二甲酸。其中最有害的杂质是对羧基苯甲醛,含量1000-5000ppm。将粗品在280-290℃、约7MPa压力下溶解于水中,然后在把催化剂存在下进行加氢处理,除去对羧基苯甲酸,经结晶、过滤、洗涤、干燥,即得纤维级对苯二甲酸。2.对二甲苯低温氧化法原料对二甲苯在醋酸溶剂中,以醋酸钴(或醋酸锰)及溴化物为催化剂,以三聚乙醛为氧化促进剂,在100-130℃温度和3MPa压力下,用空气一步低温氧化,反应产物用醋酸洗涤,然后干燥得产品对苯二甲酸。
用途: 该品绝大部分用于生产聚对苯二甲酸乙二酯(聚酯),是聚酯纤维、薄膜、塑料制品、绝缘漆及增塑剂的重要原料,也用于医药、染料及其他产品的生产。
推荐供应商
货号品牌产品名称规格包装、参考价格详情
P797035MACKLIN对苯二甲酸10mM in DMSO185元/1ml;   615元/5ml;   展开
储存:-20°C
状态:液体
P816020MACKLIN对苯二甲酸99%50元/100g;   100元/500g;   407元/2.5kg;   1600元/25kg;   1188元/12X500g;   展开
储存:室温
状态:白色粉末或晶体
T0166TCITerephthalic Acid>99.0%(GC)(T)150元/25G;   245元/500G;   展开

基本信息

纯度/分析方法>99.0%(GC)(T)
分子式/分子量C8H6O4 = 166.13
外观与形状(20℃)固体
Reaxys-RN1909333
PubChem物质ID87576161
SDBS (AIST Spectral DB)2912
Merck Index (14)9162
MDL编号MFCD00002558

技术规格

AppearanceWhite to Almost white powder to crystal
Purity(GC)min. 99.0 %
Purity(Neutralization titration)min. 99.0 %
Solubility in 1mol/L NaOHalmost transparency

物性(参考值)

熔点402 ℃(dec.)
水溶性实际上不溶
在水中的溶解度2.8 g/l   20 ℃
溶解性(可溶于)二甲基甲酰胺
溶解度(极微溶)
溶解性(不溶于)氯仿,乙醚,乙醇

安全信息

图形或危害标志
信号词危险
危险性说明H316 : 造成轻微皮肤刺激。
H320 : 造成眼刺激。
H372 : 长期或反复接触会对器官造成损害。
H335 : 可能造成呼吸道刺激。
防范说明P501 : 将内装物/容器送到批准的废物处理厂处理。
P260 : 不要吸入粉尘/ 烟/ 气体/ 烟雾/ 蒸气/ 喷雾。
P270 : 使用本产品时不要进食、饮水或吸烟。
P271 : 只能在室外或通风良好之处使用。
P264 : 作业后彻底清洗皮肤。
P314 : 如感觉不适,须求医/就诊。
P337 + P313 : 如仍觉眼刺激:求医/就诊。
P305 + P351 + P338 : 如进入眼睛:用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出,取出隐形眼镜。继续冲洗。
P332 + P313 : 如发生皮肤刺激:求医/就诊。
P304 + P340 + P312 : 如误吸入:将人转移到空气新鲜处,保持呼吸舒适体位。如感觉不适,呼叫急救中心/医生。
P403 + P233 : 存放在通风良好的地方。保持容器密闭。
P405 : 存放处须加锁。

相关法规

RTECS#WZ0875000
333492J&KTerephthalic Acid99%169元/250G;   559元/1KG;   2230元/5KG;   展开

基本信息

分子式C8H6O4
分子量166.13
熔点>300
MDL编码MFCD00002558
Beilstein1909333
Merck14,9162
EINECS 编号202-830-0

安全信息

图形或危害标志
提示语Warning
危险说明H315
H319
H335
防范说明P261
P305+P351+P338
WGK3
RTECSWZ0875000
TSCA
A12527Alfa AesarTerephthalic Acid98+%299元/250g;   508元/500g;   7294元/10000g;   展开

应用
Terephthalic acid is used in the metal organic frame works. Terephthalic acid is used primarily to make polyethylene terephthalate (PET) resins and fibers, polyester fibers, films, polyethylene terephthalate solid-state resins and polyethylene terephthalate engineering resins.

备注
Store in cool place. Keep container tightly closed in a dry and well-ventilated place. It should be stored and used in molten form.

基本信息

MDL
MFCD00002558

EINECS
202-830-0

分子式
C8H6O4

分子量
166.13

熔点
402° subl.

闪点
260°(500°F)

密度
1.510

灵敏度
Ambient temperatures.

形态
Crystalline powder

溶解性
slightly soluble in water (0,017 g/L at 25°C)

Beilstein
1909333

Merck
14,9162

GHS危害和防范说明

GHS符号

Hazard Statements
H315-H319-H335
Causes skin irritation.Causes serious eye irritation.May cause respiratory irritation.

Precautionary Statements
P261-P280a-P305+P351+P338-P304+P340-P405-P501a
Avoid breathing dust/fume/gas/mist/vapours/spray.Wear protective gloves and eye/face protection.IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing.Store locked up.Dispose of contents/container in accordance with local/regional/national/international regulations.

安全信息

危险类别
36/37/38
Irritating to eyes, respiratory system and skin.

安全等级
26-37-60
In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.This material and its container must be disposed of as hazardous waste

RTECS
WZ0875000

TSCA

C18072Alfa AesarTerephthalic Acid99+%, ACROS Organics379元/250g;   624元/500g;   1057元/1kg;   4404元/5kg;   18833元/25kg;   展开

基本信息

Ref#
18072

MDL
MFCD00002558

EINECS
202-830-0

分子式
C8 H6 O4

分子量
166.13

熔点
402° subl.

闪点
260°(500°F)

密度
1.510

形态
Solid

Beilstein
1909333

Merck
14,9162

安全信息

RTECS
WZ0875000

TSCA

185361Sigma-AldrichTerephthalic Acid98%427.34元/5 G;   516.36元/100 G;   571.57元/500 G;   展开

产品说明

一般描述

我们致力于为您提供更环保的替代产品,以符合“绿色化学的12项原则”的一项或多项原则要求。该产品为增强型,提高了能源效率。点击此处,查看更多详情。

应用

对苯二甲酸(TPA)可由生物基材料合成,用于各种应用,包括生产聚酯纤维、非纤维领域、PET瓶、合成香料和药品等。
对苯二甲酸被用作金属有机框架(MOF)制备中的连接分子。

包装

5, 100, 500 g in poly bottle

其他说明

Scripps Center for Metabolomics(斯克里普斯代谢组学中心)独立生成的串联质谱数据,可以PDF格式查看或下载。 185361.pdf 经测试的代谢物被收录在Scripps代谢组学中心METLIN代谢物数据库中。更多信息请见sigma.com/metlin。

基本信息

线性分子式C6H4-1,4-(CO2H)2
分子量166.13
Beilstein1909333
EC 号202-830-0
MDL编号MFCD00002558
eCl@ss39024105
PubChem化学物质编号24850686
NACRESNA.23

产品性质

蒸汽压<0.01 mmHg ( 20 ℃)
质量水平100
测定98%
形式powder
自燃温度925 °F
环保替代产品特性Design for Energy Efficiency
Learn more about the Principles of Green Chemistry.
mp>300 ℃ (lit.)
溶解性water: ~0.017 g/L at 25 ℃
密度1.58 g/cm3 at 25 ℃
环保替代产品分类Enabling
SMILES stringOC(=O)c1ccc(cc1)C(O)=O
InChI1S/C8H6O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H,(H,9,10)(H,11,12)
InChI keyKKEYFWRCBNTPAC-UHFFFAOYSA-N

安全信息

储存分类代码13 - Non Combustible Solids
WGKWGK 3
闪点(F)Not applicable
闪点(C)Not applicable
个人防护装备dust mask type N95 (US), Eyeshields, Gloves
8.00762Sigma-AldrichTerephthalic Acidfor synthesis232.63元/100 G;   413.17元/1 KG;   展开

产品说明

分析说明

Assay (acidimetric): ≥ 98.0 %
Identity (IR): passes test

基本信息

线性分子式C6H4-1,4-(COOH)2
分子量166.13
MDL编号MFCD00002558
EC索引号202-830-0

产品性质

质量水平200
测定≥98% (acidimetric)
形式crystalline
自燃温度496 ℃
效能>6400 mg/kg LD50, oral (Rat)
mp402 ℃ (sublimed)
溶解性 15 mg/L (experimental)
密度1.51 g/cm3 at 20 ℃
储存温度2-30℃
InChI1S/C8H6O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H,(H,9,10)(H,11,12)
InChI keyKKEYFWRCBNTPAC-UHFFFAOYSA-N

安全信息

储存分类代码11 - Combustible Solids
WGKWGK 3
闪点(F)Not applicable
闪点(C)Not applicable
40818SupelcoTerephthalic Acidanalytical standard1211.86元/100 MG;   展开

产品说明

应用

有关合适仪器技术的更多信息,请参考产品分析证书。如需进一步支持,请联系技术服务。

其他说明

Ion Mobility: TWCCSN2 value of 129.7 Å2 [M-H]-

The collision cross section (CCS) measurement was provided by Waters Corporation, using the SYNAPT XS mass spectrometer.
For a description and overview of how ion mobility enables the measurement of the CCS of an ion visit ims.waters.com.
Further information on the SYNAPT XS mass spectrometer can be found on the IMS microsite and product webpage.

TWCCS measurements are expected to be within 2% of this reference value.

P/N 40818 is part of the Waters Extractables & Leachables UNIFI scientific library which can be downloaded from Waters Marketplace.

基本信息

线性分子式C6H4-1,4-(CO2H)2
分子量166.13
Beilstein1909333
EC 号202-830-0
MDL编号MFCD00002558
PubChem化学物质编号329755948
NACRESNA.24

产品性质

质量水平100
等级analytical standard
蒸汽压<0.01 mmHg ( 20 ℃)
测定≥98.0% (GC)
97.5-102.5% (T)
自燃温度925 °F
保质期limited shelf life, expiry date on the label
technique(s)HPLC: suitable
gas chromatography (GC): suitable
mp>300 ℃ (lit.)
格式neat
SMILES stringOC(=O)c1ccc(cc1)C(O)=O
InChI1S/C8H6O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H,(H,9,10)(H,11,12)
InChI keyKKEYFWRCBNTPAC-UHFFFAOYSA-N

安全信息

储存分类代码13 - Non Combustible Solids
WGKWGK 3
闪点(F)Not applicable
闪点(C)Not applicable
358209FluorochemBenzene-1,4-dicarboxylic Acid95%220元/100g;   484元/500g;   展开

基本信息

CAS Number100-21-0
MDL NumberMFCD00002558

安全信息

图形或危害标志
危险性说明 H302: Harmful if swallowed.
H315: Causes skin irritation.
H319: Causes serious eye irritation.
H332: Harmful if inhaled.
H335: May cause respiratory irritation.
H372: Causes damage to organs Respiratory system.
H373: May cause damage to organs Urinary bladder.
H361fd: Reproductive toxicity
防范说明 P201: Obtain special instructions before use.
P202: Do not handle until all safety precautions have been read and understood.
P233: Keep container tightly closed.
P260: Do not breathe .
P261: Avoid breathing .
P264: Wash hands thoroughly after handling.
P270: Do not eat, drink or smoke when using this product.
P271: Use only outdoors or in a well-ventilated area.
P280: Wear .
P301 + P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.
P302 + P352: IF ON SKIN: Wash with plenty of soap and water.
P304: IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing..
P304 + P340: IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P312: Call a POISON CENTER or doctor/physician if you feel unwell.
P314: Get medical advice/attention if you feel unwell.
P321: Specific treatment (see relevant procedures. on this label).
P330: Rinse mouth.
P332 + P313: If skin irritation occurs: Get medical advice/ attention.
P337 + P313: If eye irritation persists: Get medical advice/attention.
P340: Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P362: Take off contaminated clothing and wash before reuse.
P403: Store in a well-ventilated place.
P403 + P233: Store in a well-ventilated place. Keep container tightly closed.
P405: Store locked up.
P501: Dispose of contents/container to in accordance with local regulation .
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